SCHEMBL25765327

SCHEMBL25765327

Clc1ccc(-n2c(-c3ccc(N4CCN(I)CC4)nc3)nc3ccncc32)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.78
▸ AOC3 Q16853 17/20 0.66

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16048406 0.88 KCNH2 (0.78) KCNH2AOC3
SCHEMBL16048114 0.88 KCNH2 (1.00) KCNH2AOC3
SCHEMBL30026179 0.88 KCNH2 (0.78) KCNH2AOC3
SCHEMBL30026427 0.88 KCNH2 (1.00) KCNH2AOC3
SCHEMBL18211848 0.86 KCNH2 (0.75) KCNH2AOC3
SCHEMBL30026073 0.86 KCNH2 (0.75) KCNH2AOC3
SCHEMBL16048548 0.86 KCNH2 (0.75) KCNH2AOC3
SCHEMBL16053770 0.85 AOC3 (0.78) KCNH2AOC3
Hydrochloric Acid SCHEMBL16048739 0.85 AOC3 (0.77) KCNH2AOC3
SCHEMBL20924524 0.84 KCNH2 (0.79) KCNH2AOC3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230190728-A1 NEW THERAPEUTIC USES OF COMPOUNDS PROXIMAGEN LLC (US) 2023-06-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230190728-A1 NEW THERAPEUTIC USES OF COMPOUNDS ACE2, TMPRSS2, IL1B KCNH2 800/4885AOC3 2604/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback